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[4-(2,4-Dimethoxybenzyl)piperazin-1-yl]- (2-methoxyphenyl)methanone
SpectraBase Compound ID LWTjZwE9CcS
InChI InChI=1S/C21H26N2O4/c1-25-17-9-8-16(20(14-17)27-3)15-22-10-12-23(13-11-22)21(24)18-6-4-5-7-19(18)26-2/h4-9,14H,10-13,15H2,1-3H3
InChIKey YBDHSGPMRYZIBV-UHFFFAOYSA-N
Mol Weight 370.45 g/mol
Molecular Formula C21H26N2O4
Exact Mass 370.189257 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GnoxOxYuToI
Name [4-(2,4-Dimethoxybenzyl)piperazin-1-yl]- (2-methoxyphenyl)methanone
Comments Computed using HOSE algorithm
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Exact Mass 370.189257321 u
Formula C21H26N2O4
InChI InChI=1S/C21H26N2O4/c1-25-17-9-8-16(20(14-17)27-3)15-22-10-12-23(13-11-22)21(24)18-6-4-5-7-19(18)26-2/h4-9,14H,10-13,15H2,1-3H3
InChIKey YBDHSGPMRYZIBV-UHFFFAOYSA-N
Molecular Weight 370.449 g/mol
SMILES C1(=C(C=CC=C1)OC)C(N1CCN(CC1)CC1=C(C=C(C=C1)OC)OC)=O